U.S. Department of EnergyOffice of Scientific and Technical Information
Materials Data on Mn5C2 by Materials Project
Abstract
Mn5C2 crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. there are three inequivalent Mn sites. In the first Mn site, Mn is bonded in a 2-coordinate geometry to three equivalent C atoms. There are two shorter (1.97 Å) and one longer (2.23 Å) Mn–C bond lengths. In the second Mn site, Mn is bonded to four equivalent C atoms to form distorted edge-sharing MnC4 tetrahedra. There are two shorter (2.01 Å) and two longer (2.03 Å) Mn–C bond lengths. In the third Mn site, Mn is bonded in a bent 150 degrees geometry to two equivalent C atoms. There is one shorter (1.98 Å) and one longer (2.01 Å) Mn–C bond length. C is bonded in a 7-coordinate geometry to seven Mn atoms.
- Publication Date:
- Other Number(s):
- mp-22749
- DOE Contract Number:
- AC02-05CH11231
- Research Org.:
- LBNL Materials Project; Lawrence Berkeley National Laboratory (LBNL), Berkeley, CA (United States)
- Sponsoring Org.:
- USDOE Office of Science (SC), Basic Energy Sciences (BES) (SC-22)
- Collaborations:
- The Materials Project; MIT; UC Berkeley; Duke; U Louvain
- Subject:
- 36 MATERIALS SCIENCE; C-Mn; Mn5C2; crystal structure
- OSTI Identifier:
- 1198945
- DOI:
- https://doi.org/10.17188/1198945
Citation Formats
Materials Data on Mn5C2 by Materials Project. United States: N. p., 2020.
Web. doi:10.17188/1198945.
Materials Data on Mn5C2 by Materials Project. United States. doi:https://doi.org/10.17188/1198945
2020.
"Materials Data on Mn5C2 by Materials Project". United States. doi:https://doi.org/10.17188/1198945. https://www.osti.gov/servlets/purl/1198945. Pub date:Wed Jul 15 00:00:00 EDT 2020
@article{osti_1198945,
title = {Materials Data on Mn5C2 by Materials Project},
abstractNote = {Mn5C2 crystallizes in the monoclinic C2/c space group. The structure is three-dimensional. there are three inequivalent Mn sites. In the first Mn site, Mn is bonded in a 2-coordinate geometry to three equivalent C atoms. There are two shorter (1.97 Å) and one longer (2.23 Å) Mn–C bond lengths. In the second Mn site, Mn is bonded to four equivalent C atoms to form distorted edge-sharing MnC4 tetrahedra. There are two shorter (2.01 Å) and two longer (2.03 Å) Mn–C bond lengths. In the third Mn site, Mn is bonded in a bent 150 degrees geometry to two equivalent C atoms. There is one shorter (1.98 Å) and one longer (2.01 Å) Mn–C bond length. C is bonded in a 7-coordinate geometry to seven Mn atoms.},
doi = {10.17188/1198945},
journal = {},
number = ,
volume = ,
place = {United States},
year = {2020},
month = {7}
}
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